SCHEMBL10619335

SCHEMBL10619335

COC(=O)CCCCCC=C1C(=O)C=CC1C=CC(CCCCCO[SiH](C)C)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ PRKCA P17252 2/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9546110 0.84 — —
SCHEMBL9546174 0.83 — —
SCHEMBL30183086 0.78 PTGER3 (0.46) PPARGALDH1A1LMNA
SCHEMBL9546461 0.78 TRPA1 (0.36) PPARGALDH1A1LMNA
SCHEMBL10619325 0.75 NFKB1 (0.37) PPARGPRKCA
SCHEMBL10619328 0.75 NFKB1 (0.37) PPARGALDH1A1PRKCA
SCHEMBL10603475 0.73 NFKB1 (0.49) PPARGALDH1A1LMNA
SCHEMBL10772968 0.73 NFKB1 (0.49) PPARGALDH1A1LMNA
SCHEMBL10603470 0.73 NFKB1 (0.49) PPARGALDH1A1LMNA
SCHEMBL10772965 0.73 NFKB1 (0.49) PPARGALDH1A1LMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4766147-A ANTITUMOR AGENTS TEIJIN LIMITED (JP) 1988-08-23 — — US disclosed
EP-0106576-B1 NOVEL 5-MEMBERED CYCLIC COMPOUNDS, PROCESS FOR THE PRODUCTION THEREOF, AND PHARMACEUTICAL USE THEREOF TEIJIN LIMITED (JP) 1988-03-09 — — EP disclosed
Send feedback